(E)-7-[2-(2-bromanyl-4-methyl-3-oxidanyl-octyl)-3-oxidanyl-cyclopentyl]hept-2-enoic acid

Systemtic Name: (E)-7-[2-(2-bromanyl-4-methyl-3-oxidanyl-octyl)-3-oxidanyl-cyclopentyl]hept-2-enoic acid Openeye Name: (E)-7-[2-(2-bromo-3-hydroxy-4-methyl-octyl)-3-hydroxy-cyclopentyl]hept-2-enoic acid CAS Name: (E)-7-[2-(2-bromo-3-hydroxy-4-methyloctyl)-3-hydroxycyclopentyl]-2-heptenoic acid IUPAC Name: (E)-7-[2-(2-bromo-3-hydroxy-4-methyloctyl)-3-hydroxycyclopentyl]hept-2-enoic acid Traditional Name: (E)-7-[2-(2-bromo-3-hydroxy-4-methyl-octyl)-3-hydroxy-cyclopentyl]hept-2-enoic acid Formula: C21H37BrO4 MolecularWeight: 433.42008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C(CC1C(CCC1O)CCCCC=CC(=O)O)Br)O

Isomeric SMILES

CCCCC(C)C(C(CC1C(CCC1O)CCCC/C=C/C(=O)O)Br)O

InChI

InChI=1S/C21H37BrO4/c1-3-4-9-15(2)21(26)18(22)14-17-16(12-13-19(17)23)10-7-5-6-8-11-20(24)25/h8,11,15-19,21,23,26H,3-7,9-10,12-14H2,1-2H3,(H,24,25)/b11-8+